SCHEMBL30503567

SCHEMBL30503567

Cn1ccc2ccc(CBr)nc21

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.47
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
PIK3CB P42338 1/20 0.30
CYP2A6 P11509 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13514036 0.82 DDB1 (0.37) DDB1CRBNPIK3CBCYP2A6
SCHEMBL23554266 0.81 CCR1 (0.47) CCR1DDB1CRBNPIK3CBCYP2A6
SCHEMBL7914425 0.71 CCR1 (0.42) CCR1DDB1CRBNPIK3CBCYP2A6
SCHEMBL22323347 0.69 DDB1 (0.39) DDB1CRBNPIK3CBCYP2A6
SCHEMBL3754475 0.69 DDB1 (0.39) DDB1CRBNPIK3CBCYP2A6
SCHEMBL19759418 0.67 DDB1 (0.37) DDB1CRBNPIK3CBCYP2A6
SCHEMBL22337647 0.67 MTNR1A (0.50) DDB1CRBN
SCHEMBL15469665 0.67 DDB1 (0.37) DDB1CRBNPIK3CBCYP2A6
SCHEMBL21663753 0.65 CDC7 (0.47) DDB1CRBNPIK3CBCYP2A6
SCHEMBL31721199 0.65 DDB1 (0.36) DDB1CRBNPIK3CBCYP2A6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 CN disclosed